SCHEMBL29264261

SCHEMBL29264261

Cc1c(-c2ccncc2)ccnc1Br

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
PARP10 Q53GL7 1/20 0.39
PARP11 Q9NR21 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 2/20 0.39
FYN P06241 1/20 0.37
PIK3CA P42336 2/20 0.37
CCNC P24863 2/20 0.37
CDK8 P49336 2/20 0.37
PABPC1 P11940 1/20 0.36
APOBEC3A P31941 1/20 0.36
EIF4H Q15056 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
PDE3B Q13370 3/20 0.34
PDE3A Q14432 3/20 0.34
HTT P42858 1/20 0.34
AURKB Q96GD4 1/20 0.34
INCENP Q9NQS7 1/20 0.34
IMPDH2 P12268 1/20 0.34
CYP1A2 P05177 2/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30957760 1.00 LMNA (0.39) LMNAPARP10PARP11GAAMAPT
SCHEMBL14975663 0.84 ALDH1A1 (0.45) PARP10PARP11MAPTPIK3CACDK8
SCHEMBL30446261 0.79 LMNA (0.42) LMNAGAAMAPTPIK3CAPABPC1
SCHEMBL27546357 0.79 GRM4 (0.46) LMNAPARP10PARP11GAAMAPT
Hydrochloric Acid SCHEMBL29628896 0.78 GRM4 (0.45) LMNAPARP10PARP11GAAMAPT
Hydrochloric Acid SCHEMBL27470087 0.78 GRM4 (0.45) LMNAPARP10PARP11GAAMAPT
Iodide SCHEMBL9618573 0.78 GRM4 (0.45) LMNAPARP10PARP11GAAMAPT
Iodide SCHEMBL31070281 0.78 GRM4 (0.45) LMNAPARP10PARP11GAAMAPT
SCHEMBL28076540 0.73 MTOR (0.41) GAACYP1A2KDM4E
SCHEMBL26259778 0.70 PARP10 (0.47) LMNAPARP10PARP11MAPTFYN

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118206736-A Viologen polymer, preparation method thereof and application thereof in weeding film 南京大学 2024-06-18 CN disclosed